Changelog

0.9.9 (2023-11-28)

Bug Fixes

default processor pass as one line data (519f412)

0.9.8 (2023-11-27)

Bug Fixes

avoid error in getNMReDataTags (3ac3aba)

0.9.7 (2023-09-21)

Bug Fixes

sdf parser result contains the extension (e5976f9)

0.9.6 (2023-09-21)

Bug Fixes

support to nmredata extension n multiple spectrum sources (#44) (bf6f2d6)

0.9.5 (2023-09-10)

Bug Fixes

ensure string in data version (91f0dd1)

0.9.4 (2023-08-24)

Bug Fixes

upgrade openchemlib-utils (#41) (d814ffb)

0.9.3 (2023-08-11)

Bug Fixes

update openchemlib-utils (#39) (395c72a)

0.9.2 (2022-11-30)

Bug Fixes

update dependencies (7a6da2d)
update openchemlib-utils to 2.1.2 (32564d9)

0.9.1 (2022-10-20)

Bug Fixes

update and simplify deps (9113f76)

0.9.0 (2022-10-03)

⚠ BREAKING CHANGES

use filecollection (#35)

Features

use filecollection (#35) (0c30f15)

0.8.0 (2022-09-20)

⚠ BREAKING CHANGES

use filelist-utils internally (#32)

Features

use filelist-utils internally (#32) (38bfb9a)

0.7.1 (2022-08-27)

Bug Fixes

assignment tag: handle when not atoms exist (#29) (6909206)

0.7.0 (2022-08-15)

Features

export json even without xy data (2fe9b09)

Bug Fixes

avoid empty lines (2a1b605)
handle correctly the smiles tag (396cd3f)
update dependencies (6cec918)

0.6.1 (2021-11-05)

Bug Fixes

refactor 2D signals property names (9f1bf66)

0.6.0 (2021-11-05)

Features

refactor integral to integration (5bf7871)

0.5.0 (2021-09-01)

⚠ BREAKING CHANGES

exports diaIDs instead of diaID

Features

exports diaIDs instead of diaID (dde8bf6)

0.4.1 (2021-07-27)

Bug Fixes

avoid throw if there is not assignment (9e68d4f)
wrong use of optional chaining operator (e4146d0)

0.4.0 (2021-05-04)

Features

nmredataToJSON: fix the exportation of 2D signal (#15) (ab25b7c)

0.3.0 (2021-04-30)

Features

add source data in json exportation (b23bdcb)
ensure explicit hydrogens (0623bc0)

Bug Fixes

1dSignal: fix wrong importation of signals 1D (90e2a84)

0.2.0 (2021-04-21)

0.0.2 (2019-04-16)

0.0.1 (2019-04-16)